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433098

Sigma-Aldrich

5-Bromo-1-indanone

97%

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About This Item

Empirical Formula (Hill Notation):
C9H7BrO
CAS Number:
Molecular Weight:
211.06
MDL number:
UNSPSC Code:
12352100
PubChem Substance ID:
NACRES:
NA.22

Quality Level

Assay

97%

mp

126-129 °C (lit.)

functional group

bromo
ketone

SMILES string

Brc1ccc2C(=O)CCc2c1

InChI

1S/C9H7BrO/c10-7-2-3-8-6(5-7)1-4-9(8)11/h2-3,5H,1,4H2

InChI key

KSONICAHAPRCMV-UHFFFAOYSA-N

General description

5-Bromo-1-indanone is a 1-indanone derivative. Its physical properties like density, freezing point and refractive index have been determined. It participates in the synthesis of the imidazolyl and triazolyl substituted biphenyl compounds.

Pictograms

Exclamation mark

Signal Word

Warning

Hazard Classifications

Acute Tox. 4 Oral - Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3

Target Organs

Respiratory system

Storage Class Code

11 - Combustible Solids

WGK

WGK 3

Flash Point(F)

Not applicable

Flash Point(C)

Not applicable

Personal Protective Equipment

dust mask type N95 (US), Eyeshields, Gloves

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Brian E Fink et al.
Bioorganic & medicinal chemistry letters, 16(6), 1532-1536 (2006-01-03)
A novel series of 17beta-hydroxysteroid dehydrogenase type 3 (17beta-HSD3) inhibitors has been identified. These inhibitors, based on a dibenzazocine core, exhibited picomolar to low nanomolar inhibition of 17beta-HSD3 in cell-free enzymatic as well as in cell-based transcriptional reporter assays.
Agustin Casimiro-Garcia et al.
Journal of medicinal chemistry, 54(12), 4219-4233 (2011-05-12)
Mining of an in-house collection of angiotensin II type 1 receptor antagonists to identify compounds with activity at the peroxisome proliferator-activated receptor-γ (PPARγ) revealed a new series of imidazo[4,5-b]pyridines 2 possessing activity at these two receptors. Early availability of the
Turn-On Fluorogenic Probes for the Selective and Quantitative Detection of the Cyanide Anion from Natural Sources.
Gomez T, et al.
Chemistry (Weinheim An Der Bergstrasse, Germany), 8(6), 1271-1278 (2013)
Y Zhuang et al.
Bioorganic & medicinal chemistry, 8(6), 1245-1252 (2000-07-15)
The synthesis of a new series of P450 17 inhibitors is described. The imidazol-1-yl compounds 5 showed strong inhibition of P450 17 rat and especially human enzyme, the most active compounds being 5ax, 5ay and 5bx with IC50 values of
Yaws CL.
The Yaws Handbook of Physical Properties for Hydrocarbons and Chemicals, 229-229 (2015)

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